2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine

C17H23N3 — CID 79828564

IUPAC2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine
SMILESCC1(C)CCCC(n2ccnc2-c2ccccc2)C1N
InChIInChI=1S/C17H23N3/c1-17(2)10-6-9-14(15(17)18)20-12-11-19-16(20)13-7-4-3-5-8-13/h3-5,7-8,11-12,14-15H,6,9-10,18H2,1-2H3
InChIKeyKFLRRHGKMDKUBK-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.63
Rot. Bonds2

About 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine

2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine (PubChem CID 79828564) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine
PubChem CID79828564
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine
SMILESCC1(C)CCCC(n2ccnc2-c2ccccc2)C1N
InChIInChI=1S/C17H23N3/c1-17(2)10-6-9-14(15(17)18)20-12-11-19-16(20)13-7-4-3-5-8-13/h3-5,7-8,11-12,14-15H,6,9-10,18H2,1-2H3
InChIKeyKFLRRHGKMDKUBK-UHFFFAOYSA-N
XLogP3.63
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine?
The IUPAC name of 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine (CID 79828564) is 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine.
What is the SMILES notation for 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine?
The canonical SMILES for 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine is CC1(C)CCCC(n2ccnc2-c2ccccc2)C1N.
What is the InChIKey of 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine?
The InChIKey is KFLRRHGKMDKUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-17(2)10-6-9-14(15(17)18)20-12-11-19-16(20)13-7-4-3-5-8-13/h3-5,7-8,11-12,14-15H,6,9-10,18H2,1-2H3.
What are the key properties of 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine?
2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine has a molecular weight of 269.39 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-(2-phenylimidazol-1-yl)cyclohexan-1-amine is sourced from PubChem (CID 79828564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).